4-chloranylaniline; 2-methylbutanoic acid

Systemtic Name: 4-chloranylaniline; 2-methylbutanoic acid Openeye Name: 4-chloroaniline; 2-methylbutanoic acid CAS Name: 4-chloroaniline; 2-methylbutanoic acid IUPAC Name: 4-chloroaniline; 2-methylbutanoic acid Traditional Name: (4-chlorophenyl)amine; 2-methylbutyric acid Formula: C11H16ClNO2 MolecularWeight: 229.70324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)O.C1=CC(=CC=C1N)Cl

Isomeric SMILES

CCC(C)C(=O)O.C1=CC(=CC=C1N)Cl

InChI

InChI=1S/C6H6ClN.C5H10O2/c7-5-1-3-6(8)4-2-5;1-3-4(2)5(6)7/h1-4H,8H2;4H,3H2,1-2H3,(H,6,7)